[gmx-users] Micellar shape

[Shan Jayasinghe]

Thank you very much.

On Wed, Feb 5, 2020 at 11:14 PM Justin Lemkul <jalemkul at vt.edu> wrote:

>
>
> On 2/5/20 12:01 AM, Shan Jayasinghe wrote:
> > Dear Gromacs Users,
> >
> > I want to determine whether I got prolate or oblate micelle in my MD
> > simulation. I calculated moment of inertia for a micelle after doing
> > clustering. I want to know  how do I determine whether it is prolate or
> > oblate depending on moment of inertia calculations.
>
> Compute the ellipticity.
>
> -Justin
>
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> Justin A. Lemkul, Ph.D.
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-- 
Best Regards
Shan Jayasinghe